8-OLEOYLOXYPYRENE-1,3,6-TRISULFONIC ACID TRISODIUM SALT

CAS No.
129786-59-0
CCD No.
CCD00065228
Formula
C34 H39 O11 S3 . 3 Na
MolWeight
788.839

Basic Information

Product Name: 8-OLEOYLOXYPYRENE-1,3,6-TRISULFONIC ACID TRISODIUM SALT
CAS: 129786-59-0
English Synonyms: 8-OLEOYLOXYPYRENE-1,3,6-TRISULFONIC ACID TRISODIUM SALT
MDL Number.: MFCD00134909
H bond acceptor: 11
H bond donor: 0
Smile: CCCCCCCC/C=C\CCCCCCCC(=O)Oc1cc(c2ccc3c(cc(c4c3c2c1cc4)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChi: InChI=1S/C34H42O11S3.3Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-32(35)45-28-22-29(46(36,37)38)25-20-21-27-31(48(42,43)44)23-30(47(39,40)41)26-19-18-24(28)33(25)34(26)27;;;/h9-10,18-23H,2-8,11-17H2,1H3,(H,36,37,38)(H,39,40,41)(H,42,43,44);;;/q;3*+1/p-3/b10-9-;;;
InChiKey: InChIKey=LBKSWHIAXQXJIU-BZKIHGKGSA-K

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